General Information of the Compound
| Compound ID |
CP0487366
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| Compound Name |
(4-Fluoro-phenyl)-[1-(3-iodo-benzyl)-piperidin-4-yl]-methanol
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| Structure |
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| Formula |
C19H21FINO
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| Molecular Weight |
425.285
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| Canonical SMILES |
OC(C1CCN(Cc2cccc(I)c2)CC1)c1ccc(F)cc1
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| InChI |
InChI=1S/C19H21FINO/c20-17-6-4-15(5-7-17)19(23)16-8-10-22(11-9-16)13-14-2-1-3-18(21)12-14/h1-7,12,16,19,23H,8-11,13H2
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| InChIKey |
YVZFDJUHGYARBA-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound